Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19285591 | 1.00 | APLNR (0.32) | APLNRCA1CA2CA9 | |
| SCHEMBL19285275 | 1.00 | APLNR (0.32) | APLNRCA1CA2CA9 | |
| SCHEMBL23687521 | 1.00 | APLNR (0.32) | APLNRCA1CA2CA9 | |
| SCHEMBL19285263 | 1.00 | APLNR (0.32) | APLNRCA1CA2CA9 | |
| SCHEMBL9052936 | 0.72 | — | — | |
| SCHEMBL19285325 | 0.72 | — | — | |
| SCHEMBL19285083 | 0.72 | — | — | |
| SCHEMBL24001736 | 0.70 | — | — | |
| SCHEMBL21084322 | 0.69 | CA2 (0.31) | CA2CA9 | |
| SCHEMBL24912191 | 0.69 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112867722-B | MACROCYCLIC SPIROETHERS (MACROCYCLIC SPIROETHERS) as MCL-1 inhibitors | 苏州亚盛药业有限公司 | 2022-09-23 | — | — | CN | disclosed |
| CN-112867722-A | MACROCYCLIC SPIROETHERS (MACROCYCLIC SPIROETHERS) as MCL-1 inhibitors | 苏州亚盛药业有限公司 | 2021-05-28 | — | — | CN | disclosed |